| SpectraBase Spectrum ID |
3RKHO5a8jRq |
| Name |
but-2-Enoylamide, 3-methyl-N-(2-pentyl)-N-heptyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
267.256214686 u |
| Formula |
C17H33NO |
| InChI |
InChI=1S/C17H33NO/c1-6-8-9-10-11-13-18(16(5)12-7-2)17(19)14-15(3)4/h14,16H,6-13H2,1-5H3 |
| InChIKey |
NCJJYBAHWYUOIZ-UHFFFAOYSA-N |
| Molecular Weight |
267.457 g/mol |
| SMILES |
C(N(C(CCC)C)C(=O)C=C(C)C)CCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.826819 |
